Transformations

Showing 101 through 200 of 5077
RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Convergence
RUN22 PET-UNK-29afea89-2_1 molecule DAR-DIA-0cde14eb-55_2 molecule −3.4 ± 0.3 work distributions convergence plot
RUN535 PET-UNK-29afea89-2_1 molecule MIC-UNK-cdc2493e-5_3 molecule −3.4 ± 0.3 work distributions convergence plot
RUN2912 PET-UNK-29afea89-2_1 molecule DAR-DIA-ecdbc7dd-18_2 molecule −3.4 ± 0.2 work distributions convergence plot
RUN293 PET-UNK-29afea89-2_1 molecule EDJ-MED-e4b030d8-10_1 molecule −3.4 ± 0.4 work distributions convergence plot
RUN1662 PET-UNK-29afea89-2_1 molecule EDG-MED-90036822-8_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN0 PET-UNK-29afea89-2_1 molecule DAR-DIA-23aa0b97-20_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN1103 PET-UNK-29afea89-2_1 molecule GIA-UNK-80c9bc96-1_2 molecule −3.3 ± 0.2 work distributions convergence plot
RUN13 PET-UNK-29afea89-2_1 molecule DAR-DIA-0cde14eb-49_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN1381 PET-UNK-29afea89-2_1 molecule DAR-DIA-5ff57136-14_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN601 PET-UNK-29afea89-2_1 molecule ADA-UCB-dc2b944c-5_1 molecule −3.3 ± 0.4 work distributions convergence plot
RUN599 PET-UNK-29afea89-2_1 molecule MIC-UNK-bcd487e9-10_1 molecule −3.3 ± 0.3 work distributions convergence plot
RUN155 PET-UNK-29afea89-2_1 molecule MIC-UNK-d36ab305-6_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN379 PET-UNK-29afea89-2_1 molecule VLA-UCB-50c39ae8-3_1 molecule −3.3 ± 0.4 work distributions convergence plot
RUN2462 PET-UNK-29afea89-2_1 molecule ALP-UNI-0676e700-18_1 molecule −3.2 ± 0.4 work distributions convergence plot
RUN2379 PET-UNK-29afea89-2_1 molecule ALP-POS-2da19ca7-5_1 molecule −3.2 ± 0.4 work distributions convergence plot
RUN2532 PET-UNK-29afea89-2_1 molecule ALP-UNI-3496895b-10_1 molecule −3.2 ± 0.4 work distributions convergence plot
RUN261 PET-UNK-29afea89-2_1 molecule MIC-UNK-9582b2c5-1_8 molecule −3.2 ± 0.5 work distributions convergence plot
RUN455 PET-UNK-29afea89-2_1 molecule NIR-WEI-acbd6416-1_1 molecule −3.2 ± 0.3 work distributions convergence plot
RUN1506 PET-UNK-29afea89-2_1 molecule LAU-MED-88a3970a-10_1 molecule −3.2 ± 0.2 work distributions convergence plot
RUN248 PET-UNK-29afea89-2_1 molecule LON-WEI-4d77710c-56_1 molecule −3.2 ± 0.2 work distributions convergence plot
RUN1773 PET-UNK-29afea89-2_1 molecule EDG-MED-90036822-77_1 molecule −3.2 ± 0.2 work distributions convergence plot
RUN2184 PET-UNK-29afea89-2_1 molecule MAT-POS-89e65850-1_1 molecule −3.2 ± 0.3 work distributions convergence plot
RUN89 PET-UNK-29afea89-2_1 molecule MAT-POS-b5746674-108_2 molecule −3.2 ± 0.2 work distributions convergence plot
RUN704 PET-UNK-29afea89-2_1 molecule MAK-UNK-ffc90da7-4_7 molecule −3.2 ± 0.2 work distributions convergence plot
RUN734 PET-UNK-29afea89-2_1 molecule MAK-UNK-83e0a0b4-4_2 molecule −3.2 ± 0.4 work distributions convergence plot
RUN264 PET-UNK-29afea89-2_1 molecule MIC-UNK-9582b2c5-2_3 molecule −3.2 ± 0.2 work distributions convergence plot
RUN555 PET-UNK-29afea89-2_1 molecule MIC-UNK-cdc2493e-13_1 molecule −3.2 ± 0.2 work distributions convergence plot
RUN373 PET-UNK-29afea89-2_1 molecule EDJ-MED-50011917-2_1 molecule −3.2 ± 0.5 work distributions convergence plot
RUN2384 PET-UNK-29afea89-2_1 molecule ALP-POS-2da19ca7-7_3 molecule −3.2 ± 0.4 work distributions convergence plot
RUN940 PET-UNK-29afea89-2_1 molecule MAK-UNK-c749d764-8_8 molecule −3.2 ± 0.2 work distributions convergence plot
RUN641 PET-UNK-29afea89-2_1 molecule VLA-UCB-34f3ed0c-17_1 molecule −3.2 ± 0.2 work distributions convergence plot
RUN610 PET-UNK-29afea89-2_1 molecule ADA-UCB-dc2b944c-11_1 molecule −3.2 ± 0.3 work distributions convergence plot
RUN280 PET-UNK-29afea89-2_1 molecule MAT-POS-bbbbc21a-3_1 molecule −3.2 ± 0.1 work distributions convergence plot
RUN3749 PET-UNK-29afea89-2_1 molecule KAD-UNI-877d7bed-11_3 molecule −3.2 ± 0.2 work distributions convergence plot
RUN1049 PET-UNK-29afea89-2_1 molecule MAK-UNK-c749d764-26_4 molecule −3.2 ± 0.3 work distributions convergence plot
RUN589 PET-UNK-29afea89-2_1 molecule MIC-UNK-bcd487e9-4_1 molecule −3.2 ± 0.2 work distributions convergence plot
RUN2897 PET-UNK-29afea89-2_1 molecule DAR-DIA-ecdbc7dd-11_1 molecule −3.1 ± 0.1 work distributions convergence plot
RUN218 PET-UNK-29afea89-2_1 molecule LON-WEI-4d77710c-28_1 molecule −3.1 ± 0.3 work distributions convergence plot
RUN485 PET-UNK-29afea89-2_1 molecule MAK-UNK-919546f0-5_1 molecule −3.1 ± 0.2 work distributions convergence plot
RUN1251 PET-UNK-29afea89-2_1 molecule RAL-THA-8416115c-2_1 molecule −3.1 ± 0.2 work distributions convergence plot
RUN967 PET-UNK-29afea89-2_1 molecule MAK-UNK-c749d764-15_12 molecule −3.1 ± 0.2 work distributions convergence plot
RUN169 PET-UNK-29afea89-2_1 molecule VLA-UCB-1dbca3b4-16_1 molecule −3.1 ± 0.3 work distributions convergence plot
RUN2714 PET-UNK-29afea89-2_1 molecule EDG-MED-ba1ac7b9-25_4 molecule −3.1 ± 0.1 work distributions convergence plot
RUN1514 PET-UNK-29afea89-2_1 molecule ALP-POS-fab80cf2-1_1 molecule −3.1 ± 0.2 work distributions convergence plot
RUN456 PET-UNK-29afea89-2_1 molecule NAU-LAT-b7d8c353-8_1 molecule −3.1 ± 0.3 work distributions convergence plot
RUN82 PET-UNK-29afea89-2_1 molecule MAT-POS-b5746674-105_1 molecule −3.1 ± 0.2 work distributions convergence plot
RUN2382 PET-UNK-29afea89-2_1 molecule ALP-POS-2da19ca7-1_1 molecule −3.1 ± 0.2 work distributions convergence plot
RUN2403 PET-UNK-29afea89-2_1 molecule MAT-POS-f9802937-9_1 molecule −3.1 ± 0.3 work distributions convergence plot
RUN833 PET-UNK-29afea89-2_1 molecule DAR-DIA-0d514e7d-31_2 molecule −3.1 ± 0.3 work distributions convergence plot
RUN275 PET-UNK-29afea89-2_1 molecule MAT-POS-bbbbc21a-1_1 molecule −3.1 ± 0.5 work distributions convergence plot
RUN244 PET-UNK-29afea89-2_1 molecule LON-WEI-4d77710c-54_1 molecule −3.1 ± 0.2 work distributions convergence plot
RUN1127 PET-UNK-29afea89-2_1 molecule JOH-SUS-a69c159d-6_2 molecule −3.1 ± 0.2 work distributions convergence plot
RUN422 PET-UNK-29afea89-2_1 molecule FRA-DIA-0fa076fe-2_1 molecule −3.1 ± 0.3 work distributions convergence plot
RUN1082 PET-UNK-29afea89-2_1 molecule MAK-UNK-c749d764-33_4 molecule −3.1 ± 0.3 work distributions convergence plot
RUN3 PET-UNK-29afea89-2_1 molecule LON-WEI-adc59df6-52_2 molecule −3.1 ± 0.3 work distributions convergence plot
RUN646 PET-UNK-29afea89-2_1 molecule VLA-UCB-34f3ed0c-19_1 molecule −3.1 ± 0.3 work distributions convergence plot
RUN459 PET-UNK-29afea89-2_1 molecule ALP-UNI-44c99a80-4_1 molecule −3.1 ± 0.3 work distributions convergence plot
RUN650 PET-UNK-29afea89-2_1 molecule EDJ-MED-28ec730d-2_1 molecule −3.1 ± 0.2 work distributions convergence plot
RUN1617 PET-UNK-29afea89-2_1 molecule ED_-GRI-5b13fbe2-63_1 molecule −3.0 ± 0.2 work distributions convergence plot
RUN326 PET-UNK-29afea89-2_1 molecule MAR-UCB-f313ec4d-2_1 molecule −3.0 ± 0.4 work distributions convergence plot
RUN165 PET-UNK-29afea89-2_1 molecule MIC-UNK-d36ab305-5_1 molecule −3.0 ± 0.2 work distributions convergence plot
RUN2268 PET-UNK-29afea89-2_1 molecule MAT-POS-e9e99895-13_2 molecule −3.0 ± 0.3 work distributions convergence plot
RUN678 PET-UNK-29afea89-2_1 molecule MIC-UNK-50cce87d-11_2 molecule −3.0 ± 0.2 work distributions convergence plot
RUN856 PET-UNK-29afea89-2_1 molecule DAR-DIA-0d514e7d-32_7 molecule −3.0 ± 0.2 work distributions convergence plot
RUN2370 PET-UNK-29afea89-2_1 molecule EDG-MED-5d232de5-8_1 molecule −3.0 ± 0.4 work distributions convergence plot
RUN1066 PET-UNK-29afea89-2_1 molecule MAK-UNK-c749d764-29_5 molecule −3.0 ± 0.3 work distributions convergence plot
RUN2634 PET-UNK-29afea89-2_1 molecule EDG-MED-ba1ac7b9-5_1 molecule −3.0 ± 0.5 work distributions convergence plot
RUN496 PET-UNK-29afea89-2_1 molecule MAK-UNK-8be7dca9-3_2 molecule −3.0 ± 0.2 work distributions convergence plot
RUN541 PET-UNK-29afea89-2_1 molecule MIC-UNK-cdc2493e-8_6 molecule −3.0 ± 0.2 work distributions convergence plot
RUN2919 PET-UNK-29afea89-2_1 molecule ALP-UNI-8e43a71e-1_2 molecule −2.9 ± 0.1 work distributions convergence plot
RUN565 PET-UNK-29afea89-2_1 molecule MIC-UNK-cdc2493e-20_1 molecule −2.9 ± 0.2 work distributions convergence plot
RUN1126 PET-UNK-29afea89-2_1 molecule JOH-SUS-a69c159d-6_1 molecule −2.9 ± 0.2 work distributions convergence plot
RUN2861 PET-UNK-29afea89-2_1 molecule ALF-EVA-650655fc-4_5 molecule −2.9 ± 0.1 work distributions convergence plot
RUN740 PET-UNK-29afea89-2_1 molecule MIC-UNK-5a93dd5f-3_1 molecule −2.9 ± 0.2 work distributions convergence plot
RUN241 PET-UNK-29afea89-2_1 molecule LON-WEI-4d77710c-51_1 molecule −2.9 ± 0.2 work distributions convergence plot
RUN2267 PET-UNK-29afea89-2_1 molecule MAT-POS-e9e99895-13_1 molecule −2.9 ± 0.3 work distributions convergence plot
RUN1032 PET-UNK-29afea89-2_1 molecule MAK-UNK-c749d764-24_3 molecule −2.9 ± 0.3 work distributions convergence plot
RUN112 PET-UNK-29afea89-2_1 molecule MAT-POS-3b92565d-3_2 molecule −2.9 ± 0.3 work distributions convergence plot
RUN440 PET-UNK-29afea89-2_1 molecule RAL-THA-1d44ff04-5_1 molecule −2.9 ± 0.4 work distributions convergence plot
RUN310 PET-UNK-29afea89-2_1 molecule MAT-POS-173a45da-1_1 molecule −2.9 ± 0.2 work distributions convergence plot
RUN1367 PET-UNK-29afea89-2_1 molecule LON-WEI-5e7d1b3e-56_1 molecule −2.9 ± 0.2 work distributions convergence plot
RUN3508 PET-UNK-29afea89-2_1 molecule MIC-UNK-0a05c952-2_4 molecule −2.9 ± 0.2 work distributions convergence plot
RUN612 PET-UNK-29afea89-2_1 molecule ADA-UCB-dc2b944c-14_1 molecule −2.9 ± 0.2 work distributions convergence plot
RUN2302 PET-UNK-29afea89-2_1 molecule KAD-UNI-80f122c8-5_2 molecule −2.9 ± 0.4 work distributions convergence plot
RUN431 PET-UNK-29afea89-2_1 molecule MIC-UNK-644c43c7-3_1 molecule −2.9 ± 0.2 work distributions convergence plot
RUN632 PET-UNK-29afea89-2_1 molecule VLA-UCB-34f3ed0c-12_1 molecule −2.9 ± 0.4 work distributions convergence plot
RUN486 PET-UNK-29afea89-2_1 molecule MAK-UNK-f481d203-3_1 molecule −2.8 ± 0.3 work distributions convergence plot
RUN1235 PET-UNK-29afea89-2_1 molecule RAL-THA-4aa06b95-4_1 molecule −2.8 ± 0.3 work distributions convergence plot
RUN903 PET-UNK-29afea89-2_1 molecule MAK-UNK-c749d764-2_7 molecule −2.8 ± 0.3 work distributions convergence plot
RUN1076 PET-UNK-29afea89-2_1 molecule MAK-UNK-c749d764-31_6 molecule −2.8 ± 0.2 work distributions convergence plot
RUN2473 PET-UNK-29afea89-2_1 molecule ALP-UNI-0676e700-24_2 molecule −2.8 ± 0.4 work distributions convergence plot
RUN102 PET-UNK-29afea89-2_1 molecule MAT-POS-2492181e-9_1 molecule −2.8 ± 0.2 work distributions convergence plot
RUN2460 PET-UNK-29afea89-2_1 molecule ALP-UNI-0676e700-11_1 molecule −2.8 ± 0.3 work distributions convergence plot
RUN2325 PET-UNK-29afea89-2_1 molecule ALP-POS-e0fe77e5-7_1 molecule −2.8 ± 0.3 work distributions convergence plot
RUN159 PET-UNK-29afea89-2_1 molecule MIC-UNK-d36ab305-4_2 molecule −2.8 ± 0.3 work distributions convergence plot
RUN184 PET-UNK-29afea89-2_1 molecule ALP-POS-f13221e1-3_1 molecule −2.8 ± 0.2 work distributions convergence plot
RUN4172 PET-UNK-29afea89-2_1 molecule PET-UNK-1b92fa34-4_1 molecule −2.8 ± 0.3 work distributions convergence plot
RUN574 PET-UNK-29afea89-2_1 molecule MIC-UNK-cdc2493e-22_1 molecule −2.8 ± 0.3 work distributions convergence plot
RUN2734 PET-UNK-29afea89-2_1 molecule EDG-MED-ba1ac7b9-28_3 molecule −2.8 ± 0.2 work distributions convergence plot
RUN533 PET-UNK-29afea89-2_1 molecule MIC-UNK-cdc2493e-5_2 molecule −2.8 ± 0.3 work distributions convergence plot
Last updated 2021-06-04T18:13:56.580002+00:00
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